☆22Sep 19, 2023Updated 2 years ago
Alternatives and similar repositories for CASMatChat
Users that are interested in CASMatChat are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Material parsers and other tools, scripts Initially developed for Grobid Superconductor☆13Feb 21, 2025Updated last year
- Calculating electron-phonon couplings with DFTB.☆10Mar 13, 2026Updated last week
- Calculates Berry connections and other properties from DFT packages☆16Updated this week
- A tool for computing k.p effective Hamiltonians with couplings to external fields including E, B, and epsilon, under given symmetry const…☆17Oct 14, 2022Updated 3 years ago
- Utilities to support interacting with multiple HPC clusters☆11Nov 21, 2025Updated 4 months ago
- A web interface for Torque Resource Manager☆19Jan 9, 2014Updated 12 years ago
- Web-Scarping tool for downloading the content of the following publishers: Elsevier, RSC, Web of Science, Springer Nature , Wiley.☆37Jun 24, 2025Updated 9 months ago
- Python tools for mean-field Hubbard models☆26Mar 7, 2026Updated 2 weeks ago
- Code repository for paper "Generative artificial intelligence GPT-4 accelerates knowledge mining and machine learning for synthetic biolo…☆13May 14, 2023Updated 2 years ago
- Workflows made easy.☆12Mar 23, 2018Updated 8 years ago
- Tutorial notebook for symmetry features in ASE☆25Nov 21, 2019Updated 6 years ago
- A package for quickly constructing k·p models of magnetic and non-magnetic crystals☆20Jan 18, 2025Updated last year
- p2pool for SIA☆15Oct 20, 2016Updated 9 years ago
- high dimensional neural network potential☆23Dec 8, 2022Updated 3 years ago
- A CUDA-implementation of linear-scaling quantum transport methods☆28Sep 28, 2023Updated 2 years ago
- Calculate ab initio spin-orbital coupling strength for Wannier tight-binding models.☆27Jan 2, 2026Updated 2 months ago
- A Docker image with GCCGO cross toolchain for OpenWRT 15.05☆24Oct 16, 2020Updated 5 years ago
- Highly configurable 2D (SVG) & 3D (threejs) visualisations for ASE/Pymatgen structures, within the Jupyter Notebook.☆36Dec 8, 2022Updated 3 years ago
- Code and data for paper named: Large language models for automatic equation discovery of nonlinear dynamics☆13Mar 6, 2025Updated last year
- 基于知识图谱的医疗问答系统☆18Aug 3, 2023Updated 2 years ago
- MCPB Bundle for connecting Claude Desktop to Macuse. Macuse is a macOS app that bridges AI assistants with native macOS functionality.☆22Mar 3, 2026Updated 3 weeks ago
- A workflow management system and web-based cluster front-end for high performance computing☆20Jun 23, 2022Updated 3 years ago
- Package for investigation of mulitlayer 2D heterostructures' lattices (Work in progress!)☆22Jan 17, 2021Updated 5 years ago
- ☆26Sep 3, 2024Updated last year
- Official code for "From Seeing to Doing: Bridging Reasoning and Decision for Robotic Manipulation" (ICLR2026)☆31Mar 1, 2026Updated 3 weeks ago
- ☆16Feb 17, 2025Updated last year
- 针对最经典的表格型Q learning算法进行了复现,能够支持gym中大多数的离散动作和状态空间的环境,譬如CliffWalking-v0。☆10Jan 2, 2021Updated 5 years ago
- to obtain parameters of kp model and Lande g-factors directly from the VASP wavefunctions. Ref: Zhang et al., Chin. Phys. Lett. 40, 1271…☆30Jun 10, 2025Updated 9 months ago
- Python-based tool to calculate instantaneous interfaces and concentration/orientation profiles from molecular simulation trajectories in …☆12Nov 5, 2019Updated 6 years ago
- Coarse-graining library that implements Force-matching☆11Aug 31, 2020Updated 5 years ago
- 通过 Python 中的 selenium 库实现自动化批量生成油库里语音☆19Nov 8, 2022Updated 3 years ago
- ☆10Oct 22, 2024Updated last year
- PhysReason Becnhmark☆19Jul 8, 2025Updated 8 months ago
- Bayesian inference of conformational populations☆13Jun 11, 2025Updated 9 months ago
- Prototype code of the tight-binding hamiltonian construction neural network model. Check the example_basic_method.py to construct a TB mo…☆32May 5, 2022Updated 3 years ago
- A collection of examples for running different types of VASP calculations.☆32Oct 30, 2016Updated 9 years ago
- Genetic algorithm to convert 3D-RISM solvent densities to explicit water molecules in binding pockets☆13Dec 19, 2017Updated 8 years ago
- A tool for constructing accurate machine learning force fields in moir\'e systems☆16Feb 12, 2026Updated last month
- ☆10Mar 18, 2024Updated 2 years ago